| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 21 | No |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -3.20 | 6.87 | -20.57 | 1 | 8 | 0 | 100 | 280.247 | 0 | ↓ |
| Mid Mid (pH 6-8) | 0.54 | 6.6 | -45.46 | 0 | 8 | -1 | 101 | 279.239 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -3.20 | 7.08 | -48.49 | 2 | 8 | 1 | 102 | 281.255 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
